Crystallography Open Database

Information card for entry 2207672

2207671 << 2207672 >> 2207673

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Structure parameters

Chemical name	trans-Diaqua(malonato)(1,10-phenanthroline)nickel(II) trihydrate
Formula	C15 H20 N2 Ni O9
Calculated formula	C15 H20 N2 Ni O9
Title of publication	<i>trans</i>-Diaqua(malonato)(1,10-phenanthroline)nickel(II) trihydrate
Authors of publication	Shu-Min Zhao; Tian-Xing Wu
Journal of publication	Acta Crystallographica Section E
Year of publication	2005
Journal volume	61
Journal issue	12
Pages of publication	m2544 - m2545
a	8.9389 ± 0.0003 Å
b	12.1466 ± 0.0004 Å
c	9.4334 ± 0.0003 Å
α	90°
β	116.189 ± 0.001°
γ	90°
Cell volume	919.11 ± 0.05 Å³
Cell temperature	295 ± 1 K
Ambient diffraction temperature	295 ± 1 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.028
Residual factor for significantly intense reflections	0.025
Weighted residual factors for significantly intense reflections	0.067
Weighted residual factors for all reflections included in the refinement	0.076
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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